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"PsiRESP: calculating RESP charges with Psi4."

Lily Wang, Megan L. O'Mara (2022)

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DOI: 10.21105/JOSS.04100

access: open

type: Journal Article

metadata version: 2022-08-16

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  - https://dblp.org/rec/journals/jossw/WangO22
Lily Wang, Megan L. O'Mara:
PsiRESP: calculating RESP charges with Psi4. J. Open Source Softw. 7(73): 4100 (2022)

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